(3E)-1-carbamothioyl-3-[(4-chlorophenyl)methylidene]thiourea

Systemtic Name: (3E)-1-carbamothioyl-3-[(4-chlorophenyl)methylidene]thiourea Openeye Name: (3E)-1-carbamothioyl-3-[(4-chlorophenyl)methylene]thiourea CAS Name: (3E)-1-carbamothioyl-3-[(4-chlorophenyl)methylidene]thiourea IUPAC Name: (3E)-1-carbamothioyl-3-[(4-chlorophenyl)methylidene]thiourea Traditional Name: (1E)-1-(4-chlorobenzylidene)-3-thiocarbamoyl-thiourea Formula: C9H8ClN3S2 MolecularWeight: 257.76292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=NC(=S)NC(=S)N)Cl

Isomeric SMILES

C1=CC(=CC=C1/C=N/C(=S)NC(=S)N)Cl

InChI

InChI=1S/C9H8ClN3S2/c10-7-3-1-6(2-4-7)5-12-9(15)13-8(11)14/h1-5H,(H3,11,13,14,15)/b12-5+